In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 15 | Yes |
Popular Name: N-isobutyl-N-[[(3R)-3-piperidyl]methyl]cyclopropanamine N-isobutyl-N-[[(3R)-3-piperidyl]…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.04 | 7.59 | -94.28 | 3 | 2 | 2 | 21 | 212.381 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 6.51 | -29.4 | 2 | 2 | 1 | 16 | 211.373 | 5 | ↓ |